SCHEMBL28061580

SCHEMBL28061580

FC(F)(F)Oc1c[c]ccc1C1CCN(c2ncccn2)CC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.42
GPR119 Q8TDV5 1/20 0.37
SCD O00767 1/20 0.36
CYP3A4 P08684 1/20 0.36
KDM4E B2RXH2 2/20 0.36
CYP2C19 P33261 1/20 0.36
SLC6A7 Q99884 1/20 0.35
MALT1 Q9UDY8 1/20 0.35
DPP4 P27487 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
PROKR1 Q8TCW9 1/20 0.34
USP30 Q70CQ3 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
P2RY1 P47900 1/20 0.33
KCNH2 Q12809 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8613370 0.81 DDB1 (0.31)
SCHEMBL28061555 0.78 JAK2 (0.37) P2RY1KCNH2
SCHEMBL28061550 0.75 HTR2C (0.42)
SCHEMBL28061557 0.74 JAK2 (0.34) PROKR1P2RY1KCNH2
SCHEMBL28061578 0.74 JAK2 (0.34) PROKR1P2RY1KCNH2
SCHEMBL14893608 0.72 AVPR1A (0.47) GPR119PROKR1MAPT
SCHEMBL28061558 0.70 HTR2A (0.40)
SCHEMBL28061588 0.70 HTR2A (0.40)
SCHEMBL28242873 0.70 RBP4 (0.41) RBP4SCDPROKR1MAPTP2RY1
SCHEMBL16689567 0.70 RBP4 (0.76) RBP4SCD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105693645-B Condensed heterocyclic compouds as ion channel modulators 吉利德科学公司 2018-10-09 CN disclosed
CN-105693645-A FUSED HETEROCYCLIC COMPOUNDS AS SODIUM CHANNEL MODULATORS 吉利德科学公司 2016-06-22 CN disclosed
CN-103649056-B Fused heterocyclic compounds as modulators of ion channels GILEAD SCIENCES, INC. (US) 2016-04-27 CN disclosed